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1(4H)-Pyridineacetic acid, 3,5-diformyl-4-methyl-, methyl ester
SpectraBase Compound ID 5qb7Rl8i2P6
InChI InChI=1S/C11H13NO4/c1-8-9(6-13)3-12(4-10(8)7-14)5-11(15)16-2/h3-4,6-8H,5H2,1-2H3
InChIKey ZEQDTMMZPRZBSN-UHFFFAOYSA-N
Mol Weight 223.23 g/mol
Molecular Formula C11H13NO4
Exact Mass 223.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1r3TWUvwFzA
Name 1(4H)-Pyridineacetic acid, 3,5-diformyl-4-methyl-, methyl ester
Alternate Name(s) 4-Methyl-3,5-diformyl-1(4H)pyridineacetic acid methyl ester Methyl (3,5-diformyl-4-methyl-1(4H)-pyridinyl)acetate
CAS Registry Number 105597-83-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO4
InChI InChI=1S/C11H13NO4/c1-8-9(6-13)3-12(4-10(8)7-14)5-11(15)16-2/h3-4,6-8H,5H2,1-2H3
InChIKey ZEQDTMMZPRZBSN-UHFFFAOYSA-N
Molecular Weight 223.228 g/mol
SMILES C1(=CN(CC(=O)OC)C=C(C1C)C=O)C=O
SPLASH splash10-0a4i-0190000000-ba9efe3d51309c0fad5a
Source of Spectrum F-44-2798-2
Wiley ID 1223896